⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL3183669 | 0.96 | — | — | |
| SCHEMBL3266512 | 0.92 | — | — | |
| SCHEMBL6534848 | 0.73 | — | — | |
| SCHEMBL6661561 | 0.70 | — | — | |
| SCHEMBL9226294 | 0.67 | — | — | |
| SCHEMBL8433289 | 0.67 | — | — | |
| SCHEMBL1486053 | 0.67 | CA12 (0.41) | — | |
| Thiourea SCHEMBL2928082 | 0.66 | — | — | |
| Thiourea SCHEMBL9443084 | 0.66 | — | — | |
| SCHEMBL3068754 | 0.64 | — | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2003060191-A2 | NON-TOXIC CORROSION-PROTECTION CONVERSION COATINGES ABSED ON COBALT | UNIVERSITY OF DAYTON (US) | 2003-07-24 | — | — | WO | disclosed |